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1-acetonyl-2-methyl-1,3-cyclopentanedione
SpectraBase Compound ID EPsqnvN61BA
InChI InChI=1S/C9H12O3/c1-6(10)5-9(2)7(11)3-4-8(9)12/h3-5H2,1-2H3
InChIKey NLOWZUTUCRHACT-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HZ4cW5c10N
Name 2-METHYL-2-(2'-OXOPROPYL)-CYCLOPENTA-1,3-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6(10)5-9(2)7(11)3-4-8(9)12/h3-5H2,1-2H3
InChIKey NLOWZUTUCRHACT-UHFFFAOYSA-N
Literature Reference Author M.P.SAMMES,P.N.MAINI
Literature Reference Citation MAGN.RES.CHEM.,25,372(1987)
Literature Reference DOI 10.1002/mrc.1260250422
Molecular Weight 168.192 g/mol
Solvent CDCl3
Source File Reference UNIW22083